N-methyl-6-oxo-N-(2-thiophen-2-ylethyl)-1H-pyridine-3-carboxamide

C13H14N2O2S — CID 79036748

IUPACN-methyl-6-oxo-N-(2-thiophen-2-ylethyl)-1H-pyridine-3-carboxamide
SMILESCN(CCc1cccs1)C(=O)c1ccc(=O)[nH]c1
InChIInChI=1S/C13H14N2O2S/c1-15(7-6-11-3-2-8-18-11)13(17)10-4-5-12(16)14-9-10/h2-5,8-9H,6-7H2,1H3,(H,14,16)
InChIKeyCEZVPGFTXLSPRO-UHFFFAOYSA-N
MW262.33 g/mol
LogP1.75
Rot. Bonds4

About N-methyl-6-oxo-N-(2-thiophen-2-ylethyl)-1H-pyridine-3-carboxamide

N-methyl-6-oxo-N-(2-thiophen-2-ylethyl)-1H-pyridine-3-carboxamide (PubChem CID 79036748) has the molecular formula C13H14N2O2S and a molecular weight of 262.33 g/mol. Its IUPAC name is N-methyl-6-oxo-N-(2-thiophen-2-ylethyl)-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-6-oxo-N-(2-thiophen-2-ylethyl)-1H-pyridine-3-carboxamide
PubChem CID79036748
Molecular FormulaC13H14N2O2S
Molecular Weight262.33 g/mol
Exact Mass262.08
IUPAC NameN-methyl-6-oxo-N-(2-thiophen-2-ylethyl)-1H-pyridine-3-carboxamide
SMILESCN(CCc1cccs1)C(=O)c1ccc(=O)[nH]c1
InChIInChI=1S/C13H14N2O2S/c1-15(7-6-11-3-2-8-18-11)13(17)10-4-5-12(16)14-9-10/h2-5,8-9H,6-7H2,1H3,(H,14,16)
InChIKeyCEZVPGFTXLSPRO-UHFFFAOYSA-N
XLogP1.75
TPSA53.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.33
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-4-(methylamino)-N-(2-thiophen-2-ylethyl)benzamide
CID 79487638
N-cyclopropyl-6-oxo-N-(thiophen-2-ylmethyl)-1H-pyridine-3-carboxamide
CID 56811644
3-[methyl-(6-oxo-1H-pyridine-3-carbonyl)amino]propanoic acid
CID 60989966
methyl 3-[methyl-(6-oxo-1H-pyridine-3-carbonyl)amino]propanoate
CID 54980402
N-methyl-N-(2-thiophen-2-ylethyl)-2H-triazole-4-carboxamide
CID 79036798
4-amino-3-bromo-N-methyl-N-(2-thiophen-2-ylethyl)benzamide
CID 79494740
4-amino-3,5-dichloro-N-methyl-N-(2-thiophen-2-ylethyl)benzamide
CID 82833096
3-bromo-N-methyl-N-(2-thiophen-2-ylethyl)thiophene-2-carboxamide
CID 79036876
5-amino-N-methyl-N-(2-thiophen-2-ylethyl)-1H-pyrazole-4-carboxamide
CID 79487631
3-hydroxy-N-methyl-4-nitro-N-(2-thiophen-2-ylethyl)benzamide
CID 103712023
2-amino-N-methyl-N-(2-thiophen-2-ylethyl)benzamide
CID 79019362
N-methyl-2-sulfanyl-N-(2-thiophen-2-ylethyl)benzamide
CID 107032184

Frequently Asked Questions

What is the IUPAC name of N-methyl-6-oxo-N-(2-thiophen-2-ylethyl)-1H-pyridine-3-carboxamide?
The IUPAC name of N-methyl-6-oxo-N-(2-thiophen-2-ylethyl)-1H-pyridine-3-carboxamide (CID 79036748) is N-methyl-6-oxo-N-(2-thiophen-2-ylethyl)-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-methyl-6-oxo-N-(2-thiophen-2-ylethyl)-1H-pyridine-3-carboxamide?
The canonical SMILES for N-methyl-6-oxo-N-(2-thiophen-2-ylethyl)-1H-pyridine-3-carboxamide is CN(CCc1cccs1)C(=O)c1ccc(=O)[nH]c1.
What is the InChIKey of N-methyl-6-oxo-N-(2-thiophen-2-ylethyl)-1H-pyridine-3-carboxamide?
The InChIKey is CEZVPGFTXLSPRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O2S/c1-15(7-6-11-3-2-8-18-11)13(17)10-4-5-12(16)14-9-10/h2-5,8-9H,6-7H2,1H3,(H,14,16).
What are the key properties of N-methyl-6-oxo-N-(2-thiophen-2-ylethyl)-1H-pyridine-3-carboxamide?
N-methyl-6-oxo-N-(2-thiophen-2-ylethyl)-1H-pyridine-3-carboxamide has a molecular weight of 262.33 g/mol, XLogP of 1.75, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-oxo-N-(2-thiophen-2-ylethyl)-1H-pyridine-3-carboxamide is sourced from PubChem (CID 79036748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).